(3S,3'S,4R,4'R)-5,5',7,7'-Tetrahydroxy-4,4'-bis(4-hydroxyphenyl)-3,3',4,4'-tetrahydro-2H,2'H-3,3'-bichromene-2,2'-dione

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Systematic / IUPAC Name: (3S,3'S,4R,4'R)-5,5',7,7'-Tetrahydroxy-4,4'-bis(4-hydroxyphenyl)-3,3',4,4'-tetrahydro-2H,2'H-3,3'-bichromene-2,2'-dione

ID: Reference7476

Other Names: [3,3'-Bi-2H-1-Benzopyran]-2,2'-dione, 3,3',4,4'-tetrahydro-5,5',7,7'-tetrahydroxy-4,4'-bis(4-hydroxyphenyl)-, (3S,3'S,4R,4'R)-

Formula: C30H22O10

Spectral Data

(3S,3'S,4R,4'R)-5,5',7,7'-Tetrahydroxy-4,4'-bis(4-hydroxyphenyl)-3,3',4,4'-tetrahydro-2H,2'H-3,3'-bichromene-2,2'-dione mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 162
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 3/2/2018 10:02:21 AM
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Identificators

InChI InChI=1S/C30H22O10/c31-15-5-1-13(2-6-15)23-25-19(35)9-17(33)11-21(25)39-29(37)27(23)28-24(14-3-7-16(32)8-4-14)26-20(36)10-18(34)12-22(26)40-30(28)38/h1-12,23-24,27-28,31-36H/t23-,24-,27+,28+/m1/s1
InChI Key WCAMADNGWUBZMH-ZBVBGGFBSA-N
Canonical SMILES C1=CC(=CC=C1C2C(C(=O)OC3=CC(=CC(=C23)O)O)C4C(C5=C(C=C(C=C5OC4=O)O)O)C6=CC=C(C=C6)O)O
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Other Names [3,3'-Bi-2H-1-Benzopyran]-2,2'-dione, 3,3',4,4'-tetrahydro-5,5',7,7'-tetrahydroxy-4,4'-bis(4-hydroxyphenyl)-, (3S,3'S,4R,4'R)-

In Other Databases

PubChem 24150647
ChemSpider 21686549